Geometry & MOs

Info

ID:	289450
PubChem CID:	104354448
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	303.175378
ΔH_f, kcal/mol:	-49.93
Dipole, Da:	3.43
IP(EA), eV:	-9.99(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenyl)-1-(3-methyl-1-adamantyl)ethanamine

Drug info:

PubChemData

Smile

CC(C#N)C(=O)C12CC3CC(C1)CC(C3)(C2)C

DOS

IR

Vibrations